Vitas-M small molecule compound

[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][2-(4-ethoxyphenyl)quinolin-4-yl]methanone

Catalog ID
STL178369
SMILES CCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H29N3O4 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4/c1-2-35-23-10-8-22(9-11-23)27-18-25(24-5-3-4-6-26(24)31-27)30(34)33-15-13-32(14-16-33)19-21-7-12-28-29(17-21)37-20-36-28/h3-12,17-18H,2,13-16,19-20H2,1H3
InChIKey
QFXVLOGKEKTMHG-UHFFFAOYSA-N
Synonyms

(4(13benzodioxol5ylmethyl)piperazin1yl)(2(4ethoxyphenyl)quinolin4yl)methanone
CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6
InChI=1SC30H29N3O4c12352310822(91123)271825(24534626(24)3127)30(34)33151332(141633)19217122829(1721)37203628h3121718H213161920H21H3
MFCD03390786
ZINC000000672053
ZINC00672053
ZINC672053

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Available files

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